SCHEMBL7752022

SCHEMBL7752022

CC(C)(C)C1(O)CCSCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4729116 0.78
SCHEMBL1090888 0.73
SCHEMBL12971961 0.73 OPRM1 (0.36) OPRM1OPRD1OPRK1OPRL1
SCHEMBL15187736 0.71 OPRM1 (0.35) OPRM1OPRD1OPRK1OPRL1
SCHEMBL579902 0.71 OPRM1 (0.35) OPRM1OPRD1OPRK1OPRL1
SCHEMBL10176080 0.71
Potassium SCHEMBL9297432 0.69 OPRM1 (0.34) OPRM1OPRD1OPRK1OPRL1
SCHEMBL209627 0.67
SCHEMBL8820710 0.67 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1
SCHEMBL1090751 0.67 OPRM1 (0.33) OPRM1OPRD1OPRK1OPRL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001035938-A2 PHARMACOLOGICALLY ACTIVE TETRAHYDRO THIOPYRAN-4-OL DERIVATIVES, METHOD FOR THEIR PRODUCTION AND USE THEREOF DR. WILLMAR SCHWABE GMBH & CO. (DE) 2001-05-25 WO disclosed